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learningmatter-mit / NeuralForceField Public

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Enable MD workflows for any ASE calculator#39

Open

steinmig wants to merge 6 commits intolearningmatter-mit:masterlearningmatter-mit/NeuralForceField:masterfrom

steinmig:general-potential-in-biased-mdsteinmig/NeuralForceField:general-potential-in-biased-mdCopy head branch name to clipboard

Conversation Commits6 (6)Checks Files changed

Open

Enable MD workflows for any ASE calculator#39
steinmig wants to merge 6 commits intolearningmatter-mit:masterfrom
steinmig:general-potential-in-biased-md

Commits

Commits on Jul 22, 2025

more information in batch
steinmig
committed
type and force inclusion fixes
steinmig
committed
add new classmethod to load foundation models based on path
steinmig
committed
cleanup
steinmig
committed
introduce general potential
steinmig
committed

Commits on Aug 26, 2025

Merge remote-tracking branch 'origin/master' into general-potential-in-biased-md
steinmig
committed

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